(4aR,10bR)-4,10b-dimethyl-3-oxidanylidene-2,4a,5,6-tetrahydro-1H-benzo[f]quinoline-8-carboxylic acid

Systemtic Name: (4aR,10bR)-4,10b-dimethyl-3-oxidanylidene-2,4a,5,6-tetrahydro-1H-benzo[f]quinoline-8-carboxylic acid Openeye Name: (4aR,10bR)-4,10b-dimethyl-3-oxo-2,4a,5,6-tetrahydro-1H-benzo[f]quinoline-8-carboxylic acid CAS Name: (4aR,10bR)-4,10b-dimethyl-3-oxo-2,4a,5,6-tetrahydro-1H-benzo[f]quinoline-8-carboxylic acid IUPAC Name: (4aR,10bR)-4,10b-dimethyl-3-oxo-2,4a,5,6-tetrahydro-1H-benzo[f]quinoline-8-carboxylic acid Traditional Name: (4aR,10bR)-3-keto-4,10b-dimethyl-2,4a,5,6-tetrahydro-1H-benzo[f]quinoline-8-carboxylic acid Formula: C16H19NO3 MolecularWeight: 273.32696

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC12CCC(=O)N(C1CCC3=C2C=CC(=C3)C(=O)O)C

Isomeric SMILES

C[C@]12CCC(=O)N([C@@H]1CCC3=C2C=CC(=C3)C(=O)O)C

InChI

InChI=1S/C16H19NO3/c1-16-8-7-14(18)17(2)13(16)6-4-10-9-11(15(19)20)3-5-12(10)16/h3,5,9,13H,4,6-8H2,1-2H3,(H,19,20)/t13-,16-/m1/s1